2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine

C16H21N7O — CID 126650950

IUPAC2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine
SMILESCc1nc2c(N)nc3ccccc3c2n1CCOCCN=C(N)N
InChIInChI=1S/C16H21N7O/c1-10-21-13-14(11-4-2-3-5-12(11)22-15(13)17)23(10)7-9-24-8-6-20-16(18)19/h2-5H,6-9H2,1H3,(H2,17,22)(H4,18,19,20)
InChIKeyFMTRVEVGVJYHDK-UHFFFAOYSA-N
MW327.39 g/mol
LogP0.77
Rot. Bonds6

About 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine

2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine (PubChem CID 126650950) has the molecular formula C16H21N7O and a molecular weight of 327.39 g/mol. Its IUPAC name is 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine.

Molecular Properties

Compound Name2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine
PubChem CID126650950
Molecular FormulaC16H21N7O
Molecular Weight327.39 g/mol
Exact Mass327.18
IUPAC Name2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine
SMILESCc1nc2c(N)nc3ccccc3c2n1CCOCCN=C(N)N
InChIInChI=1S/C16H21N7O/c1-10-21-13-14(11-4-2-3-5-12(11)22-15(13)17)23(10)7-9-24-8-6-20-16(18)19/h2-5H,6-9H2,1H3,(H2,17,22)(H4,18,19,20)
InChIKeyFMTRVEVGVJYHDK-UHFFFAOYSA-N
XLogP0.77
TPSA130.36 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[2-(4-amino-2-ethylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine
CID 126651376
1-[2-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethoxy]ethyl]-2-methylimidazo[4,5-c]quinolin-4-amine
CID 23450084
2-[4-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)butyl]guanidine;hydrochloride
CID 126650986
2-amino-N-[2-[2-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]-5-(diaminomethylideneamino)pentanamide;ethane
CID 162737190
N-[4-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)butyl]-2-methylpropanamide
CID 23512692
2-[2-[4-amino-2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]ethoxy]ethylcarbamic acid
CID 90884300
N-[3-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)propyl]butanamide
CID 23512673
3-[2-[4-amino-2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]ethoxy]propane-1-sulfonamide
CID 68996460
N-[2-[2-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]benzamide
CID 20608822
3-[2-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)ethoxy]propane-1-sulfinate
CID 139451645
2-ethyl-1-propylimidazo[4,5-c]quinolin-4-amine
CID 143008317
2-(ethoxymethyl)-1-ethylimidazo[4,5-c]quinolin-4-amine
CID 122646444

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine?
The IUPAC name of 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine (CID 126650950) is 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine.
What is the SMILES notation for 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine?
The canonical SMILES for 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine is Cc1nc2c(N)nc3ccccc3c2n1CCOCCN=C(N)N.
What is the InChIKey of 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine?
The InChIKey is FMTRVEVGVJYHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7O/c1-10-21-13-14(11-4-2-3-5-12(11)22-15(13)17)23(10)7-9-24-8-6-20-16(18)19/h2-5H,6-9H2,1H3,(H2,17,22)(H4,18,19,20).
What are the key properties of 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine?
2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine has a molecular weight of 327.39 g/mol, XLogP of 0.77, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)ethoxy]ethyl]guanidine is sourced from PubChem (CID 126650950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).